SCHEMBL4047010

SCHEMBL4047010

COC1CCCN([C@@H](C)CN)C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
DPP4 P27487 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
MAP4K4 O95819 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12026428 0.80 KDM2B (0.37) DPP4DPP7MAP4K4HRH3
SCHEMBL21476048 0.80 KDM2B (0.37) DPP4DPP7MAP4K4HRH3
SCHEMBL749969 0.80 KDM2B (0.37) DPP4DPP7MAP4K4HRH3
SCHEMBL21130809 0.78 HRH3 (0.35) DPP4HRH3
SCHEMBL3822046 0.78 HRH3 (0.35) DPP4HRH3
SCHEMBL21204683 0.74 DPP4 (0.32) DPP4DPP7HRH3
SCHEMBL21779876 0.73 HRH3 (0.43) HRH3
SCHEMBL21779953 0.73 HRH3 (0.43) HRH3
SCHEMBL15018879 0.71 HRH3 (0.44) HRH3
SCHEMBL16279294 0.71 HRH3 (0.44) HRH3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2038264-A1 TETRAZOLE-SUBSTITUTED ARYLAMIDES F.HOFFMANN-LA ROCHE AG (CH) 2009-03-25 EP disclosed
WO-2008000645-A1 TETRAZOLE-SUBSTITUTED ARYLAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2008-01-03 WO disclosed